(3,5-dibromophenyl) carbamate

C7H5Br2NO2 — CID 175177777

IUPAC(3,5-dibromophenyl) carbamate
SMILESNC(=O)Oc1cc(Br)cc(Br)c1
InChIInChI=1S/C7H5Br2NO2/c8-4-1-5(9)3-6(2-4)12-7(10)11/h1-3H,(H2,10,11)
InChIKeyFCFGRRVBNUTAPA-UHFFFAOYSA-N
MW294.93 g/mol
LogP2.67
Rot. Bonds1

About (3,5-dibromophenyl) carbamate

(3,5-dibromophenyl) carbamate (PubChem CID 175177777) has the molecular formula C7H5Br2NO2 and a molecular weight of 294.93 g/mol. Its IUPAC name is (3,5-dibromophenyl) carbamate.

Molecular Properties

Compound Name(3,5-dibromophenyl) carbamate
PubChem CID175177777
Molecular FormulaC7H5Br2NO2
Molecular Weight294.93 g/mol
Exact Mass292.87
IUPAC Name(3,5-dibromophenyl) carbamate
SMILESNC(=O)Oc1cc(Br)cc(Br)c1
InChIInChI=1S/C7H5Br2NO2/c8-4-1-5(9)3-6(2-4)12-7(10)11/h1-3H,(H2,10,11)
InChIKeyFCFGRRVBNUTAPA-UHFFFAOYSA-N
XLogP2.67
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.93
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3,5-dibromophenyl) carbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-(4-bromophenyl)phenyl] carbamate
CID 151826430
(4-amino-3,5-dimethylphenyl) carbamate
CID 175292870
(2-amino-4-bromo-6-chlorophenyl) carbamate
CID 131183552
(6-bromoquinolin-3-yl) carbamate
CID 175521488
[4-bromo-3-(2-hydroxypropan-2-yl)phenyl] carbamate
CID 175021652
[3-chloro-5-(difluoromethoxy)phenyl] carbamate
CID 174190375
(3,5-dibromophenyl) 2-[[(2-aminoacetyl)amino]methyl]butanoate
CID 70059203
(3,4-dimethoxy-5-methylphenyl) carbamate
CID 137496304
[3-bromo-5-(trifluoromethoxy)phenyl]methyl carbamate
CID 175168242
(8-bromoquinolin-3-yl) carbamate
CID 175146907
2-[3-bromo-5-(trifluoromethyl)phenoxy]-2-methylpropanamide
CID 165412307
(3,5-dibromobenzoyl) 3,5-dibromobenzoate
CID 101290900

Frequently Asked Questions

What is the IUPAC name of (3,5-dibromophenyl) carbamate?
The IUPAC name of (3,5-dibromophenyl) carbamate (CID 175177777) is (3,5-dibromophenyl) carbamate.
What is the SMILES notation for (3,5-dibromophenyl) carbamate?
The canonical SMILES for (3,5-dibromophenyl) carbamate is NC(=O)Oc1cc(Br)cc(Br)c1.
What is the InChIKey of (3,5-dibromophenyl) carbamate?
The InChIKey is FCFGRRVBNUTAPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5Br2NO2/c8-4-1-5(9)3-6(2-4)12-7(10)11/h1-3H,(H2,10,11).
What are the key properties of (3,5-dibromophenyl) carbamate?
(3,5-dibromophenyl) carbamate has a molecular weight of 294.93 g/mol, XLogP of 2.67, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dibromophenyl) carbamate is sourced from PubChem (CID 175177777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).